ChemSpider 2D Image | (2R)-2-{[4-(Benzylamino)-8-isopropylpyrazolo[1,5-a][1,3,5]triazin-2-yl]amino}-1-butanol | C19H26N6O

(2R)-2-{[4-(Benzylamino)-8-isopropylpyrazolo[1,5-a][1,3,5]triazin-2-yl]amino}-1-butanol

  • Molecular FormulaC19H26N6O
  • Average mass354.449 Da
  • Monoisotopic mass354.216797 Da
  • ChemSpider ID24700216

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

Validated by Experts, Validated by Users, Non-Validated, Removed by Users

(2R)-2-{[4-(benzylamino)-8-(1-methylethyl)pyrazolo[1,5-a][1,3,5]triazin-2-yl]amino}butan-1-ol
(2R)-2-{[4-(Benzylamino)-8-isopropylpyrazolo[1,5-a][1,3,5]triazin-2-yl]amino}-1-butanol [German] [ACD/IUPAC Name]
(2R)-2-{[4-(Benzylamino)-8-isopropylpyrazolo[1,5-a][1,3,5]triazin-2-yl]amino}-1-butanol [ACD/IUPAC Name]
(2R)-2-{[4-(Benzylamino)-8-isopropylpyrazolo[1,5-a][1,3,5]triazin-2-yl]amino}-1-butanol [French] [ACD/IUPAC Name]
1-Butanol, 2-[[8-(1-methylethyl)-4-[(phenylmethyl)amino]pyrazolo[1,5-a]-1,3,5-triazin-2-yl]amino]-, (2R)- [ACD/Index Name]
(2R)-2-{[4-(benzylamino)-8-(propan-2-yl)pyrazolo[1,5-a][1,3,5]triazin-2-yl]amino}butan-1-ol
(2R)-2-{[4-(benzylamino)-8-isopropylpyrazolo[1,5-a][1,3,5]triazin-2-yl]amino}butan-1-ol
https://www.ebi.ac.uk/chembl/compoundreportcard/CHEMBL482193/
pyrazolo[1,5-a]-1,3,5-triazine, 7a

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.3±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.643
Molar Refractivity: 102.0±0.5 cm3
#H bond acceptors: 7
#H bond donors: 3
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 2.86
ACD/LogD (pH 5.5): 2.30
ACD/BCF (pH 5.5): 32.63
ACD/KOC (pH 5.5): 420.48
ACD/LogD (pH 7.4): 2.30
ACD/BCF (pH 7.4): 32.96
ACD/KOC (pH 7.4): 424.80
Polar Surface Area: 87 Å2
Polarizability: 40.4±0.5 10-24cm3
Surface Tension: 47.4±7.0 dyne/cm
Molar Volume: 281.9±7.0 cm3

Click to predict properties on the Chemicalize site


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